(4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone

C15H21NO3 — CID 43421593

IUPAC(4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
SMILESCCOc1ccc(C(=O)N2CCCCC2CO)cc1
InChIInChI=1S/C15H21NO3/c1-2-19-14-8-6-12(7-9-14)15(18)16-10-4-3-5-13(16)11-17/h6-9,13,17H,2-5,10-11H2,1H3
InChIKeyUXHCKDRTZZZAEO-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.07
Rot. Bonds4

About (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone

(4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone (PubChem CID 43421593) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
PubChem CID43421593
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name(4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
SMILESCCOc1ccc(C(=O)N2CCCCC2CO)cc1
InChIInChI=1S/C15H21NO3/c1-2-19-14-8-6-12(7-9-14)15(18)16-10-4-3-5-13(16)11-17/h6-9,13,17H,2-5,10-11H2,1H3
InChIKeyUXHCKDRTZZZAEO-UHFFFAOYSA-N
XLogP2.07
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(bromomethyl)azepan-1-yl]-(4-ethoxyphenyl)methanone
CID 116639619
[2-(hydroxymethyl)piperidin-1-yl]-[4-(2-methylprop-2-enoxy)phenyl]methanone
CID 46986550
(3-amino-4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 61094073
(4-ethoxyphenyl)-[(2R)-2-(2-imidazol-1-ylethyl)piperidin-1-yl]methanone
CID 96573519
(4-fluorophenyl)-[(2S)-2-(hydroxymethyl)piperidin-1-yl]methanone
CID 40620751
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
2-(4-ethoxyphenyl)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]ethanone
CID 61408770
(2S)-1-(4-ethoxybenzoyl)pyrrolidine-2-carboxylic acid
CID 818098
[2-(hydroxymethyl)azepan-1-yl]-(4-propan-2-ylphenyl)methanone
CID 116636276
(2-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 43421165
(3-amino-4-ethoxyphenyl)-[2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 61411281
[2-(hydroxymethyl)azepan-1-yl]-[4-(3-hydroxyprop-1-ynyl)phenyl]methanone
CID 116636799

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone?
The IUPAC name of (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone (CID 43421593) is (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone is CCOc1ccc(C(=O)N2CCCCC2CO)cc1.
What is the InChIKey of (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone?
The InChIKey is UXHCKDRTZZZAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-2-19-14-8-6-12(7-9-14)15(18)16-10-4-3-5-13(16)11-17/h6-9,13,17H,2-5,10-11H2,1H3.
What are the key properties of (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone?
(4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone has a molecular weight of 263.34 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 43421593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).